SCHEMBL968283

SCHEMBL968283

COc1ccc2[nH]c3c(c2c1)CNCC3

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.79
CYP1A2 P05177 2/20 0.79
CYP2D6 P10635 2/20 0.79
ALOX15 P16050 2/20 0.79
TSHR P16473 2/20 0.79
LMNA P02545 1/20 0.79
THRB P10828 1/20 0.79
NFKB1 P19838 1/20 0.79
RECQL P46063 1/20 0.79
PMP22 Q01453 1/20 0.79
KMT2A Q03164 2/20 0.73
RAD52 P43351 1/20 0.73
ADRA2A P08913 1/20 0.62
ADRA2B P18089 1/20 0.62
ADRA2C P18825 1/20 0.62
HTR7 P34969 1/20 0.62
NISCH Q9Y2I1 1/20 0.62
USP2 O75604 1/20 0.58
CYP2C9 P11712 1/20 0.58
HTR1D P28221 1/20 0.58

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL18346074 0.99 HSD17B10 (0.77) HSD17B10CYP1A2CYP2D6ALOX15TSHR
SCHEMBL2970063 0.90 HSD17B10 (0.81) HSD17B10CYP1A2CYP2D6ALOX15TSHR
SCHEMBL21114810 0.88 HTR7 (0.79) HSD17B10CYP1A2CYP2D6ALOX15TSHR
SCHEMBL329762 0.88 HSD17B10 (1.00) HSD17B10CYP1A2CYP2D6ALOX15TSHR
SCHEMBL29440302 0.88 HSD17B10 (1.00) HSD17B10CYP1A2CYP2D6ALOX15TSHR
Hydrochloric Acid SCHEMBL31117399 0.88 SIRT2 (0.64) HSD17B10CYP1A2CYP2D6ALOX15TSHR
Hydrochloric Acid SCHEMBL31670342 0.87 HSD17B10 (0.97) HSD17B10CYP1A2CYP2D6ALOX15TSHR
SCHEMBL30741594 0.86 HSD17B10 (0.76) HSD17B10CYP1A2CYP2D6ALOX15TSHR
SCHEMBL29171344 0.86 HSD17B10 (0.76) HSD17B10CYP1A2CYP2D6ALOX15TSHR
SCHEMBL30741605 0.86 HSD17B10 (0.76) HSD17B10CYP1A2CYP2D6ALOX15TSHR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 76 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10751330-B2 Human therapeutic agents ANKH LIFE SCIENCES LIMITED (IE) 2020-08-25 US claimed
US-20200147061-A1 HUMAN THERAPEUTIC AGENTS ANKH LIFE SCIENCES LIMITED (IE) 2020-05-14 US claimed
US-10092550-B2 Therapeutic compositions containing curcumin, harmine, and isovanillin components, and methods of use thereof IONS PHARMACEUTICAL S.À R.L. (LU) 2018-10-09 US claimed
US-20170105975-A1 THERAPEUTIC COMPOSITIONS CONTAINING HARMINE AND ISOVANILLIN COMPONENTS, AND METHODS OF USE THEREOF IONS PHARMACEUTICAL S.À R.L. (LU) 2017-04-20 US claimed
US-20170042865-A1 THERAPEUTIC COMPOSITIONS CONTAINING CURCUMIN, HARMINE, AND ISOVANILLIN COMPONENTS, AND METHODS OF USE THEREOF IONS PHARMACEUTICAL S.À R.L. (LU) 2017-02-16 US claimed
WO-2016181220-A2 THERAPEUTIC COMPOSITIONS AND METHODS OF USE THEREOF IONS PHARMACEUTICAL S.À R.L. (LU) 2016-11-17 WO claimed
US-20250367173-A1 ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE-1 INHIBITORS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME LIGACHEM BIOSCIENCES INC (KR) 2025-12-04 US disclosed
EP-4540245-A1 ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE-1 INHIBITORS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME LigaChem Biosciences Inc. (KR) 2025-04-23 EP disclosed
CN-119654323-A External nucleotide pyrophosphatase-phosphodiesterase-1 inhibitor and pharmaceutical composition containing the same 瑞嘉化学生物科学股份有限公司 2025-03-18 CN disclosed
US-20250059209-A1 THERAPEUTIC AGENTS AND USES THEREOF ANKH LIFE SCIENCES LIMITED (IE) 2025-02-20 US disclosed
US-20240390294-A1 INHIBITION OF COVID-19 VIRUS BY MULTIPLE-COMPONENT FORMULATIONS ANKH LIFE SCIENCES LIMITED (IE) 2024-11-28 US disclosed
US-20240285592-A1 HUMAN THERAPEUTIC AGENTS ANKH LIFE SCIENCES LIMITED (IE) 2024-08-29 US disclosed
US-12053440-B2 Inhibition of COVID-19 virus by formulations containing curcumin, harmine, and isovanillin ANKH LIFE SCIENCES LIMITED (IE) 2024-08-06 US disclosed
EP-1725553-B1 TETRAHYDROPYRIDOINDOLE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2008-05-07 EP disclosed
WO-2007096743-A1 SUBSTITUTED QUINAZOLINES AS PDE10 INHIBITORS PFIZER PRODUCTS INC. (US) 2007-08-30 WO disclosed
US-20070191416-A1 Tetrahydropyridoindole derivatives IDORSIA PHARMACEUTICALS LTD (CH) 2007-08-16 US disclosed
EP-1725553-A1 TETRAHYDROPYRIDOINDOLE DERIVATIVES Actelion Pharmaceuticals Ltd. (CH) 2006-11-29 EP disclosed
EP-1592684-A1 MALONAMIDE DERIVATIVES AS GAMMA-SECRETASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2005-11-09 EP disclosed
WO-2005095397-A1 TETRAHYDROPYRIDOINDOLE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2005-10-13 WO disclosed
WO-2004069826-A1 MALONAMIDE DERIVATIVES AS GAMMA-SECRETASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2004-08-19 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (11 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20250367173-A1 ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE-1 INHIBITORS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME ENPP1, ENPP3, SMPD1 HSD17B10 1652/4885CYP1A2 2090/4885CYP2D6 1408/4885
US-20250059209-A1 THERAPEUTIC AGENTS AND USES THEREOF MCL1, RNASE1, HNMT HSD17B10 4006/4885CYP1A2 4210/4885CYP2D6 3248/4885
US-10751330-B2 Human therapeutic agents INMT, HNMT, HASPIN HSD17B10 1697/4885CYP1A2 2166/4885CYP2D6 2367/4885
US-20240285592-A1 HUMAN THERAPEUTIC AGENTS INMT, NLN, MYC HSD17B10 2529/4885CYP1A2 2789/4885CYP2D6 3707/4885
US-20170042865-A1 THERAPEUTIC COMPOSITIONS CONTAINING CURCUMIN, HARMINE, AND ISOVANILLIN COMPONENTS, AND METHODS OF USE THEREOF INMT, HNMT, CPT1A HSD17B10 1570/4885CYP1A2 1194/4885CYP2D6 2218/4885
US-10092550-B2 Therapeutic compositions containing curcumin, harmine, and isovanillin components, and methods of use thereof INMT, HNMT, CPT1A HSD17B10 1570/4885CYP1A2 1194/4885CYP2D6 2218/4885
US-12053440-B2 Inhibition of COVID-19 virus by formulations containing curcumin, harmine, and isovanillin MAVS, IDO2, IDO1 HSD17B10 1881/4885CYP1A2 362/4885CYP2D6 744/4885
US-20170105975-A1 THERAPEUTIC COMPOSITIONS CONTAINING HARMINE AND ISOVANILLIN COMPONENTS, AND METHODS OF USE THEREOF INMT, HNMT, COMT HSD17B10 1467/4885CYP1A2 1507/4885CYP2D6 2503/4885
US-20200147061-A1 HUMAN THERAPEUTIC AGENTS INMT, HNMT, HASPIN HSD17B10 1697/4885CYP1A2 2166/4885CYP2D6 2367/4885
US-20070191416-A1 Tetrahydropyridoindole derivatives TPH2, TPH1, HTR2C HSD17B10 1331/4885CYP1A2 55/4885CYP2D6 35/4885
US-20240390294-A1 INHIBITION OF COVID-19 VIRUS BY MULTIPLE-COMPONENT FORMULATIONS MAVS, IDO2, IDO1 HSD17B10 1502/4885CYP1A2 392/4885CYP2D6 861/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.